SCHEMBL6820765

SCHEMBL6820765

Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.[Ru]

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.94
CCR5 P51681 2/20 0.94
CCR8 P51685 2/20 0.94
METAP2 P50579 1/20 0.61
UHRF1 Q96T88 1/20 0.59
CYP2A6 P11509 1/20 0.55
KDM4E B2RXH2 2/20 0.54
NOS2 P35228 2/20 0.54
MEN1 O00255 1/20 0.54
NOS3 P29474 1/20 0.54
NOS1 P29475 1/20 0.54
KMT2A Q03164 1/20 0.54
PLAU P00749 1/20 0.43
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6820852 1.00 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL181893 0.97 CCR1 (1.00) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL29397106 0.97 CCR1 (1.00) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL2258309 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
Hydrochloric Acid SCHEMBL5549447 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL32670845 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
Hydrochloric Acid SCHEMBL9639295 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL31482991 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL15664136 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1
SCHEMBL31482988 0.94 CCR1 (0.94) CCR1CCR5CCR8METAP2UHRF1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307410-A Preparation method of chiral secondary alcohol compound 武汉大学 2024-07-09 CN claimed
CN-114605237-A Preparation method and application of fluoroalkyl ketone compound 武汉大学 2022-06-10 CN claimed
CN-114456206-A Alpha-fluoroalkyl substituted cyclopropenyl ether (alcohol), preparation method and application thereof 武汉大学 2022-05-10 CN claimed
CN-114456134-A Alpha-fluoroalkyl substituted cyclopropyl alcohol compound, and preparation method and application thereof 武汉大学 2022-05-10 CN claimed
CN-114605237-A Preparation method and application of fluoroalkyl ketone compound 武汉大学 2022-06-10 CN disclosed
CN-114456134-A Alpha-fluoroalkyl substituted cyclopropyl alcohol compound, and preparation method and application thereof 武汉大学 2022-05-10 CN disclosed
CN-114456206-A Alpha-fluoroalkyl substituted cyclopropenyl ether (alcohol), preparation method and application thereof 武汉大学 2022-05-10 CN disclosed
EP-1035124-B1 Borate compound, and photopolymerizable composition and recording material which contains the same FUJI PHOTO FILM CO LTD (JP) 2004-05-26 EP disclosed
US-20030077542-A1 Photopolymerizable composition, recording material and image forming method FUJI PHOTO FILM CO., LTD. 2003-04-24 US disclosed
US-6528230-B1 Dye precursor which can form color through contact with base FUJI PHOTO FILM CO., LTD. (JP) 2003-03-04 US disclosed
EP-0983277-B1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION CIBA SC HOLDING AG (CH) 2003-01-22 EP disclosed
US-6416922-B2 DRY PROCESSING PHOTOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 2002-07-09 US disclosed
US-6045974-A ADDITION PHOTOPOLYMERIZATION OF NONVOLATILE MONOMERIC, OLIGOMERIC OR POLYMERIC COMPOUNDS CONTAINING AT LEAST ONE ETHYLENICALLY UNSATURATED DOUBLE BOND CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-04-04 US disclosed
EP-0983277-A1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION Ciba SC Holding AG (CH) 2000-03-08 EP disclosed
US-6011180-A Acid-stable borates for photopolymerization CIBA SPECIALTY CHEMICALS CORPORATION 2000-01-04 US disclosed
US-5952152-A POLYMERIZABLE MIXTURE COMPRISING AT LEAST ONE ETHYLENICALLY UNSATURATED COMPOUND AND AN ANIONIC BORON COMPOUND ACTIVATOR CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-14 US disclosed
US-5932393-A Borate photoinitiators from monoboranes CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
WO-1998052952-A1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-11-26 WO disclosed
US-5807905-A POLYMERIZATION OF UNSATURATED COMPOUNDS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-09-15 US disclosed
EP-0775706-A2 Borates photoinitiators from polyboranes Ciba SC Holding AG (CH) 1997-05-28 EP disclosed